Finite-size effects of diffusion coefficients computed from molecular dynamics: a review of what we have learned so far
The number of molecules used in a typical Molecular Dynamics (MD) simulations is orders
of magnitude lower than in the thermodynamic limit. It is therefore essential to correct …
of magnitude lower than in the thermodynamic limit. It is therefore essential to correct …
A comprehensive review on the flow behaviour in shale gas reservoirs: Multi‐scale, multi‐phase, and multi‐physics
An accurate description of fluid flow is critical for the prediction of the productivity of shale
gas reservoirs. In this paper, we present the current advances and a systematic summary on …
gas reservoirs. In this paper, we present the current advances and a systematic summary on …
Mathematical analysis on an asymmetrical wavy motion of blood under the influence entropy generation with convective boundary conditions
In this article, we discuss the entropy generation on the asymmetric peristaltic propulsion of
non-Newtonian fluid with convective boundary conditions. The Williamson fluid model is …
non-Newtonian fluid with convective boundary conditions. The Williamson fluid model is …
An empirical experimental observations and md simulation data-based model for the material properties of confined fluids in nano/angstrom size tubes
The transport of fluids in nanometer and Angstrom-sized pores has gotten much attention
because of its potential uses in nanotechnology, energy storage, and healthcare sectors …
because of its potential uses in nanotechnology, energy storage, and healthcare sectors …
Unraveling the molecular interface and boundary problems in an electrical double layer and electroosmotic flow
M Masuduzzaman, BH Kim - Langmuir, 2022 - ACS Publications
In a nanofluidic system, the electroosmotic flow (EOF) is a complex fluid transport
mechanism, where the formation of an electrical double layer (EDL) occurs ubiquitously at …
mechanism, where the formation of an electrical double layer (EDL) occurs ubiquitously at …
Scale effects in nanoscale heat transfer for fourier's law in a dissimilar molecular interface
M Masuduzzaman, BH Kim - ACS omega, 2020 - ACS Publications
The dependence of the heat transfer of a nanoscopic liquid channel residing at the solid–
liquid interface is traditionally ascribed to the temperature jump, interfacial thermal …
liquid interface is traditionally ascribed to the temperature jump, interfacial thermal …
Mesoscopic method to study water flow in nanochannels with different wettability
Molecular dynamics (MD) simulations is currently the most popular and credible tool to
model water flow in nanoscale where the conventional continuum equations break down …
model water flow in nanoscale where the conventional continuum equations break down …
Lattice Boltzmann simulation of liquid flow in nanoporous media
In this paper, a multi-relaxation-time lattice Boltzmann (LB) model for nanoscale liquid flow is
established to investigate the liquid flow characteristics in nanoporous media. The slip …
established to investigate the liquid flow characteristics in nanoporous media. The slip …
Electro-osmotic flow in hydrophobic nanochannels
Hydrophobic surfaces with large slip lengths have the potential to enhance electro-osmotic
flows. Existing theories of electroosmosis in hydrophobic channels postulate immobile …
flows. Existing theories of electroosmosis in hydrophobic channels postulate immobile …
Applied electric field effects on diffusivity and electrical double‐layer thickness
This study utilizes molecular dynamics (MD) simulations and continuum frameworks to
explore electroosmotic flow (EOF) in nanoconfined aqueous electrolytes, offering a …
explore electroosmotic flow (EOF) in nanoconfined aqueous electrolytes, offering a …